4-[3-(4-methylphenyl)-1-phenylprop-2-enyl]morpholine

C20H23NO — CID 3607406

IUPAC4-[3-(4-methylphenyl)-1-phenylprop-2-enyl]morpholine
SMILESCc1ccc(C=CC(c2ccccc2)N2CCOCC2)cc1
InChIInChI=1S/C20H23NO/c1-17-7-9-18(10-8-17)11-12-20(19-5-3-2-4-6-19)21-13-15-22-16-14-21/h2-12,20H,13-16H2,1H3
InChIKeyLIKVTAYVOLCPGB-UHFFFAOYSA-N
MW293.41 g/mol
LogP4.08
Rot. Bonds4

About 4-[3-(4-methylphenyl)-1-phenylprop-2-enyl]morpholine

4-[3-(4-methylphenyl)-1-phenylprop-2-enyl]morpholine (PubChem CID 3607406) has the molecular formula C20H23NO and a molecular weight of 293.41 g/mol. Its IUPAC name is 4-[3-(4-methylphenyl)-1-phenylprop-2-enyl]morpholine.

Molecular Properties

Compound Name4-[3-(4-methylphenyl)-1-phenylprop-2-enyl]morpholine
PubChem CID3607406
Molecular FormulaC20H23NO
Molecular Weight293.41 g/mol
Exact Mass293.18
IUPAC Name4-[3-(4-methylphenyl)-1-phenylprop-2-enyl]morpholine
SMILESCc1ccc(C=CC(c2ccccc2)N2CCOCC2)cc1
InChIInChI=1S/C20H23NO/c1-17-7-9-18(10-8-17)11-12-20(19-5-3-2-4-6-19)21-13-15-22-16-14-21/h2-12,20H,13-16H2,1H3
InChIKeyLIKVTAYVOLCPGB-UHFFFAOYSA-N
XLogP4.08
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[3-(4-methylphenyl)-1-phenylprop-2-enyl]morpholine?
The IUPAC name of 4-[3-(4-methylphenyl)-1-phenylprop-2-enyl]morpholine (CID 3607406) is 4-[3-(4-methylphenyl)-1-phenylprop-2-enyl]morpholine.
What is the SMILES notation for 4-[3-(4-methylphenyl)-1-phenylprop-2-enyl]morpholine?
The canonical SMILES for 4-[3-(4-methylphenyl)-1-phenylprop-2-enyl]morpholine is Cc1ccc(C=CC(c2ccccc2)N2CCOCC2)cc1.
What is the InChIKey of 4-[3-(4-methylphenyl)-1-phenylprop-2-enyl]morpholine?
The InChIKey is LIKVTAYVOLCPGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO/c1-17-7-9-18(10-8-17)11-12-20(19-5-3-2-4-6-19)21-13-15-22-16-14-21/h2-12,20H,13-16H2,1H3.
What are the key properties of 4-[3-(4-methylphenyl)-1-phenylprop-2-enyl]morpholine?
4-[3-(4-methylphenyl)-1-phenylprop-2-enyl]morpholine has a molecular weight of 293.41 g/mol, XLogP of 4.08, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(4-methylphenyl)-1-phenylprop-2-enyl]morpholine is sourced from PubChem (CID 3607406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).